[(2R)-1-oxidanyl-3-[6-(phenylmethoxycarbonylamino)hexanoyloxy]propan-2-yl] octadecanoate

Systemtic Name: [(2R)-1-oxidanyl-3-[6-(phenylmethoxycarbonylamino)hexanoyloxy]propan-2-yl] octadecanoate Openeye Name: [(1R)-1-[6-(benzyloxycarbonylamino)hexanoyloxymethyl]-2-hydroxy-ethyl] octadecanoate CAS Name: octadecanoic acid [(2R)-1-hydroxy-3-[1-oxo-6-(phenylmethoxycarbonylamino)hexoxy]propan-2-yl] ester IUPAC Name: [(2R)-1-hydroxy-3-[6-(phenylmethoxycarbonylamino)hexanoyloxy]propan-2-yl] octadecanoate Traditional Name: stearic acid [(1R)-1-[6-(benzyloxycarbonylamino)hexanoyloxymethyl]-2-hydroxy-ethyl] ester Formula: C35H59NO7 MolecularWeight: 605.84546

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OC(CO)COC(=O)CCCCCNC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)O[C@H](CO)COC(=O)CCCCCNC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C35H59NO7/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-20-26-34(39)43-32(28-37)30-41-33(38)25-21-17-22-27-36-35(40)42-29-31-23-18-16-19-24-31/h16,18-19,23-24,32,37H,2-15,17,20-22,25-30H2,1H3,(H,36,40)/t32-/m1/s1